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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50311964   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein kinase C theta type


(Homo sapiens (Human))
BDBM50311964
PNG
(4-(4-methyl-1H-indol-5-ylamino)-5-(4-(4-methylpipe...)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1
Show InChI InChI=1S/C28H28N6O2S/c1-20-25-11-12-31-27(25)10-9-26(20)32-28-22(18-30-19-23(28)17-29)6-3-21-4-7-24(8-5-21)37(35,36)34-15-13-33(2)14-16-34/h3-12,18-19,31H,13-16H2,1-2H3,(H,30,32)/b6-3+
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 23n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCtheta


Bioorg Med Chem Lett 19: 6575-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.031
BindingDB Entry DOI: 10.7270/Q2KD1Z1F
More data for this
Ligand-Target Pair
Protein kinase C delta type


(Homo sapiens (Human))
BDBM50311964
PNG
(4-(4-methyl-1H-indol-5-ylamino)-5-(4-(4-methylpipe...)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1ccc(\C=C\c2cncc(C#N)c2Nc2ccc3[nH]ccc3c2C)cc1
Show InChI InChI=1S/C28H28N6O2S/c1-20-25-11-12-31-27(25)10-9-26(20)32-28-22(18-30-19-23(28)17-29)6-3-21-4-7-24(8-5-21)37(35,36)34-15-13-33(2)14-16-34/h3-12,18-19,31H,13-16H2,1-2H3,(H,30,32)/b6-3+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 140n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of PKCdelta


Bioorg Med Chem Lett 19: 6575-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.031
BindingDB Entry DOI: 10.7270/Q2KD1Z1F
More data for this
Ligand-Target Pair